4-[2-(4,4-diethyl-7-hexyl-thiochroman-6-yl)ethynyl]benzoic acid

Molecular Formula: C₂₈H₃₄O₂S

InChI: InChI=1/C28H34O2S/c1-4-7-8-9-10-23-20-26-25(28(5-2,6-3)17-18-31-26)19-24(23)16-13-21-11-14-22(15-12-21)27(29)30/h11-12,14-15,19-20H,4-10,17-18H2,1-3H3,(H,29,30)/f/h29H

InChIKey: InChIKey=HKMCBVFKAJLLBS-PKRZOPRNCT
SMILES: CCCCCCC1=CC2=C(C=C1C#CC3=CC=C(C=C3)C(=O)O)C(CCS2)(CC)CC

Names:
    4-[2-(4,4-diethyl-7-hexyl-thiochroman-6-yl)ethynyl]benzoic acid

Registries:
    PubChem CID 9889151
    PubChem ID 14856782